General Information of the Compound
| Compound ID |
CP0536619
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| Compound Name |
4-[(2,4,6-trimethylphenyl)sulfamoyl]benzoic acid
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| Structure |
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| Formula |
C16H17NO4S
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| Molecular Weight |
319.382
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| Canonical SMILES |
Cc1cc(C)c(NS(=O)(=O)c2ccc(cc2)C(O)=O)c(C)c1
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| InChI |
InChI=1S/C16H17NO4S/c1-10-8-11(2)15(12(3)9-10)17-22(20,21)14-6-4-13(5-7-14)16(18)19/h4-9,17H,1-3H3,(H,18,19)
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| InChIKey |
JSFRYSBQMVKXDL-UHFFFAOYSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound